2,6-Toluene diisocyanate

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Systematic / IUPAC Name: 1,3-Diisocyanato-2-methylbenzene

ID: Reference7257

Other Names: 2,6-TDI;
Desmodur T 80;
Hylene-T ;
Mondur-TD ;
Nacconate-100 ; more

Formula: C9H6N2O2

Class: Extractables/Leachables

Spectral Data

2,6-Toluene diisocyanate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 1978
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/28/2018 9:40:32 AM
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Identificators

InChI InChI=1S/C9H6N2O2/c1-7-8(10-5-12)3-2-4-9(7)11-6-13/h2-4H,1H3
InChI Key RUELTTOHQODFPA-UHFFFAOYSA-N
Canonical SMILES CC1=C(C=CC=C1N=C=O)N=C=O
CAS 91087
Splash
Other Names 2,6-TDI;
Desmodur T 80;
Hylene-T ;
Mondur-TD ;
Nacconate-100;
Rubinate TDI ;
m-Tolylene diisocyanate;
m-Tolylidene diisocyanate;
1,3-Diisocyanato-2-methyl-benzene;
1,3-Diisocyanatomethylbenzene;
2,6-Diisocyanato-1-methylbenzene;
2,6-Diisocyanatotoluene;
2,6-Toluenediisocyanate;
2,6-Tolylene diisocyanate;
2-Methyl-m-phenylene diisocyanate;
2-Methyl-m-phenylene isocyanate;
Benzene, 1,3-diisocyanato-2-methyl-;
Benzene, 2,6-diisocyanato-1-methyl-;
Diisocyanatotoluene;
Isocyanic acid, 2-methyl-m-phenylene ester;
Isocyanic acid, methyl-m-phenylene ester;
Methyl-m-phenylene diisocyanate;
Methyl-m-phenylene isocyanate;
Methylphenylene isocyanate;
Toluene 2,6-diisocyanate;
Tolylene 2,6-diisocyanate;
Tolylene isocyanate

In Other Databases

ChemIDPlus 000091087; 009019856; 031370613; 037302708; 063368956; 051160362; 053679542; 066072228; 052390757; 009017010
Wikipedia Toluene_diisocyanate
ChEMBL CHEMBL1443390
PubChem 7040
ChemSpider 6773
ChEBI CHEBI:53557